SCHEMBL12096889

SCHEMBL12096889

Cc1ccc2c(c1)cc(Cc1ccc(C(=O)O)cc1)n2S(=O)(=O)c1cccc(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 12/20 0.50
▸ PPARA Q07869 11/20 0.50
▸ PPARD Q03181 9/20 0.46
▸ RXRA P19793 3/20 0.39
▸ RXRB P28702 2/20 0.39
▸ RARA P10276 1/20 0.37
▸ RARB P10826 1/20 0.37
▸ RARG P13631 1/20 0.37
▸ CCR9 P51686 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC11 Q96DB2 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ ACLY P53396 1/20 0.36
▸ SRD5A2 P31213 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12096747 0.93 PPARG (0.46) PPARGPPARAPPARDRXRARXRB
SCHEMBL12096873 0.90 PPARG (0.41) PPARGPPARAPPARDRXRARXRB
SCHEMBL12096845 0.89 PPARG (0.42) PPARGPPARAPPARDRXRARXRB
SCHEMBL12096713 0.89 PPARG (0.53) PPARGPPARAPPARDSRD5A2
SCHEMBL12096795 0.84 PPARG (0.54) PPARGPPARAPPARDSRD5A2
SCHEMBL12096640 0.83 RORC (0.46) PPARGPPARAPPARDHDAC3HDAC11
SCHEMBL12096685 0.83 RXRA (0.39) PPARGRXRARXRBRARARARB
SCHEMBL12096716 0.83 PPARG (0.67) PPARGPPARAPPARDACLY
SCHEMBL14053489 0.82 TP53 (0.39) PPARGPPARAPPARDRXRARXRB
SCHEMBL27950245 0.82 PPARG (0.35) PPARGPPARAPPARDRXRARXRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120232070-A1 Use of Indole Derivatives as Nurr-1 Activators for the Application Thereof as a Medicament for the Treatment of Parkinson's Disease LABORATOIRES FOURNIER SA (FR) 2012-09-13 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120232070-A1 Use of Indole Derivatives as Nurr-1 Activators for the Application Thereof as a Medicament for the Treatment of Parkinson's Disease NCOR1, NR0B1, MTNR1A PPARG 423/4885PPARA 564/4885PPARD 302/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback